NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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N-[(6-fluoro-1H-1,3-benzodiazol-2-yl)methyl]-N-methyl-2-(trifluoromethyl)pyrimidin-4-amine
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IUPAC Traditional name
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N-[(5-fluoro-3H-1,3-benzodiazol-2-yl)methyl]-N-methyl-2-(trifluoromethyl)pyrimidin-4-amine
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Synonyms
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N-[(6-fluoro-1H-benzimidazol-2-yl)methyl]-N-methyl-2-(trifluoromethyl)pyrimidin-4-amine
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DATA SOURCES
DATA SOURCES
All Sources Commercial Sources Non-commercial Sources
CALCULATED PROPERTIES
CALCULATED PROPERTIES
JChem
供应商提供(Chembridge)
Acid pKa
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11.07032
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H Acceptors
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4
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H Donor
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1
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LogD (pH = 5.5)
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3.663135
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LogD (pH = 7.4)
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3.8115175
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Log P
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3.8138928
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Molar Refractivity
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76.1655 cm3
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Polarizability
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28.111897 Å3
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Polar Surface Area
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57.7 Å2
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Rotatable Bonds
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4
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Lipinski's Rule of Five
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true
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H Acceptors
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3
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H Donor
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1
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Log P
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2.01
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LOG S
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-3.22
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Polar Surface Area
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57.7 Å2
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Rotatable Bonds
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4
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PROPERTIES
PROPERTIES
Bioassay(PubChem)
PATENTS
PATENTS
PubChem Patent
Google Patent